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Aspen Physical Property System - Physical Property Models

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At the pure fused salt state:<br />

The symmetric reference state defined by Eq. 3 is restricted to systems<br />

containing a single electrolyte component. For multi-electrolyte systems, the<br />

symmetric reference state can be generalized from Eq. 3 as follows:<br />

120 2 Thermodynamic <strong>Property</strong> <strong>Models</strong><br />

(6)<br />

(7)<br />

(8)<br />

(9)<br />

(10)<br />

where I applies to all molecular components in the system. The symmetric<br />

reference state is a molecular-component-free media.<br />

Infinite-dilution aqueous solution<br />

The condition of infinite-dilution solution for ionic components can be written<br />

as follows:<br />

(11)<br />

This condition applies to all ionic components in the solution. In infinitedilution<br />

aqueous solutions, water must be present and is assumed to<br />

represent the entire solution, so the unsymmetric reference state can be<br />

written as follows:<br />

This equation applies to all ionic components in the solution.<br />

NRTL-SAC Local Composition Term<br />

The segment-based excess Gibbs free energy of the local interactions for<br />

systems with multiple molecular segments m and a single electrolyte segment<br />

e (with a single cation segment c and anion segment a) can be written as<br />

follows:<br />

(12)<br />

(13)<br />

(14)

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